Molecular Identity
Miglustat
(2R,3R,4R,5S)-1-butyl-2-(hydroxymethyl)piperidine-3,4,5-triol
PubChem CID: 51634
Miglustat is a hydroxypiperidine that is deoxynojirimycin in which the amino hydrogen is replaced by a butyl group. It has a role as an EC 2.4.1.80 (ceramide glucosyltransferase) inhibitor and an anti-HIV agent. It is a member of piperidines and a tertiary amino compound. It is functionally related to a duvoglustat.
2D Structure
Properties
C10H21NO4
Molecular Formula
219.28
Molecular Weight
g/mol
219.1471
Exact Mass
Da
-0.6
XLogP
Drug-like (Lipinski: < 5)
84.2
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
5
H-Bond Acceptors
190
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Miglustat72599-27-0ZavescaN-Butyldeoxynojirimycin(2R,3R,4R,5S)-1-butyl-2-(hydroxymethyl)piperidine-3,4,5-triolNB-DNJButyldeoxynojirimycinN-ButylmoranolineN-butyl-1-deoxynojirimycinBuDNJn-Butyl deoxynojirimycinN-(n-Butyl)deoxynojirimycinSC-48334OGT-918miglustatum
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Miglustat
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